COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK998460
Chemical Name: 1-[4-(3,4-dichlorophenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]butan-1-one
Smiles: CCCC(=O)c1c(c2ccccc2)c2c3n1cc(n3CCCC2)c1ccc(c(c1)Cl)Cl

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Molecular Weight: 451.39
Empirical Formula: C26H24Cl2N2O

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 7.994
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 26
Number of rings: 5

     

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